4-methyl-2-(4-propan-2-yl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine

C15H24N4O — CID 114739024

IUPAC4-methyl-2-(4-propan-2-yl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine
SMILESCC(C)c1nc(C2CN(C)CCO2)nc2c1CNCC2
InChIInChI=1S/C15H24N4O/c1-10(2)14-11-8-16-5-4-12(11)17-15(18-14)13-9-19(3)6-7-20-13/h10,13,16H,4-9H2,1-3H3
InChIKeyBISFWNWTOYUIBO-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.25
Rot. Bonds2

About 4-methyl-2-(4-propan-2-yl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine

4-methyl-2-(4-propan-2-yl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine (PubChem CID 114739024) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 4-methyl-2-(4-propan-2-yl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine.

Molecular Properties

Compound Name4-methyl-2-(4-propan-2-yl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine
PubChem CID114739024
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name4-methyl-2-(4-propan-2-yl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine
SMILESCC(C)c1nc(C2CN(C)CCO2)nc2c1CNCC2
InChIInChI=1S/C15H24N4O/c1-10(2)14-11-8-16-5-4-12(11)17-15(18-14)13-9-19(3)6-7-20-13/h10,13,16H,4-9H2,1-3H3
InChIKeyBISFWNWTOYUIBO-UHFFFAOYSA-N
XLogP1.25
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(4-propan-2-yl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine?
The IUPAC name of 4-methyl-2-(4-propan-2-yl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine (CID 114739024) is 4-methyl-2-(4-propan-2-yl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine.
What is the SMILES notation for 4-methyl-2-(4-propan-2-yl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine?
The canonical SMILES for 4-methyl-2-(4-propan-2-yl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine is CC(C)c1nc(C2CN(C)CCO2)nc2c1CNCC2.
What is the InChIKey of 4-methyl-2-(4-propan-2-yl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine?
The InChIKey is BISFWNWTOYUIBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-10(2)14-11-8-16-5-4-12(11)17-15(18-14)13-9-19(3)6-7-20-13/h10,13,16H,4-9H2,1-3H3.
What are the key properties of 4-methyl-2-(4-propan-2-yl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine?
4-methyl-2-(4-propan-2-yl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine has a molecular weight of 276.38 g/mol, XLogP of 1.25, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(4-propan-2-yl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)morpholine is sourced from PubChem (CID 114739024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).